Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CCR1 | P32246 | 5/20 | 0.42 |
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5244366 | 0.91 | CCR1 (0.45) | LMNACCR1ROCK2ALDH1A1 | |
| SCHEMBL5244456 | 0.89 | LMNA (0.57) | LMNASMOALDH1A1HDAC1 | |
| SCHEMBL5249308 | 0.86 | RIPK1 (0.46) | LMNACCR1SMOCYP2C9ROCK2 | |
| SCHEMBL5248174 | 0.85 | POLB (0.48) | LMNACCR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL5246022 | 0.85 | CCR1 (0.43) | LMNACCR1CYP2C9ROCK2CYP3A4 | |
| SCHEMBL5246361 | 0.85 | CCR1 (0.49) | LMNACCR1ROCK2HDAC1 | |
| SCHEMBL5244694 | 0.85 | HPGD (0.48) | LMNACYP2C9ROCK2ROCK1ALDH1A1 | |
| SCHEMBL5244318 | 0.85 | CCR1 (0.59) | CCR1CYP3A4CYP2D6CYP1A2CYP2C19 | |
| SCHEMBL5245295 | 0.85 | LMNA (0.44) | LMNACCR1SMOCYP2C9ROCK2 | |
| SCHEMBL5246674 | 0.84 | ROCK2 (0.53) | LMNACCR1CYP2C9ROCK2CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |